dimethyl benzene-1,2-dicarboxylate; phenyl(piperidin-1-yl)methanone

Systemtic Name: dimethyl benzene-1,2-dicarboxylate; phenyl(piperidin-1-yl)methanone Openeye Name: dimethyl benzene-1,2-dicarboxylate; phenyl(1-piperidyl)methanone CAS Name: benzene-1,2-dicarboxylic acid dimethyl ester; phenyl(1-piperidinyl)methanone IUPAC Name: dimethyl benzene-1,2-dicarboxylate; phenyl(piperidin-1-yl)methanone Traditional Name: benzene-1,2-dicarboxylic acid dimethyl ester; phenyl(piperidino)methanone Formula: C22H25NO5 MolecularWeight: 383.4376

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1C(=O)OC.C1CCN(CC1)C(=O)C2=CC=CC=C2

Isomeric SMILES

COC(=O)C1=CC=CC=C1C(=O)OC.C1CCN(CC1)C(=O)C2=CC=CC=C2

InChI

InChI=1S/C12H15NO.C10H10O4/c14-12(11-7-3-1-4-8-11)13-9-5-2-6-10-13;1-13-9(11)7-5-3-4-6-8(7)10(12)14-2/h1,3-4,7-8H,2,5-6,9-10H2;3-6H,1-2H3